SCHEMBL10445693

SCHEMBL10445693

CCCCCCCCCCCCCCCCCCOc1cn(-c2ccccc2)c(O)cc1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
NR1I2 O75469 1/20 0.44
LMNA P02545 1/20 0.44
CHRM2 P08172 1/20 0.44
CYP3A4 P08684 1/20 0.44
ADRA2A P08913 1/20 0.44
MAPT P10636 1/20 0.44
OPRK1 P41145 1/20 0.44
HTR2B P41595 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
PTPN11 Q06124 2/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
PLA2G2A P14555 1/20 0.40
FGFR1 P11362 1/20 0.40
CNR2 P34972 1/20 0.40
SMPD1 P17405 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8136252 0.85 COMT (0.56) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL8136432 0.82 PTPN11 (0.41) MEN1NR1I2LMNACHRM2CYP3A4
Bromide SCHEMBL9290785 0.81 PTPN11 (0.40) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL8138025 0.74 COMT (0.47)
SCHEMBL8130166 0.72 COMT (0.44) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL8119797 0.72 COMT (0.44) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL8137012 0.72 COMT (0.44) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL8137123 0.72 COMT (0.44) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL6901759 0.71 COMT (0.60) PTPN11
SCHEMBL6901895 0.70 COMT (0.46) LMNAPTPN11ALDH1A1FGFR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0354495-A1 Alkoxy-4(1H)-pyridone derivatives, process for their preparation and their pharmaceutical use GÖDECKE AKTIENGESELLSCHAFT (DE) 1990-02-14 EP disclosed